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S-[4-[(2S)-butan-2-yl]oxyphenyl] N-(2-methylbut-3-yn-2-yl)carbamothioate
S-[4-[(2S)-butan-2-yl]oxyphenyl] N-(2-methylbut-3-yn-2-yl)carbamothioate
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Descriptors Computed from Structure
Canonical SMILES:
CCC(C)OC1=CC=C(C=C1)SC(=O)NC(C)(C)C#C
Isomeric SMILES
CC[C@H](C)OC1=CC=C(C=C1)SC(=O)NC(C)(C)C#C
InChI
InChI=1S/C16H21NO2S/c1-6-12(3)19-13-8-10-14(11-9-13)20-15(18)17-16(4,5)7-2/h2,8-12H,6H2,1,3-5H3,(H,17,18)/t12-/m0/s1
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- 3-(3-hydroxyphenyl)propanoic acid
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- S-[4-[(2S)-butan-2-yl]oxyphenyl] N-pent-1-yn-3-ylcarbamothioate
- S-[4-[(2S)-butan-2-yl]phenyl] N-(2-methylbut-3-yn-2-yl)carbamothioate
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- (5S)-5-cyclohexa-1,3-dien-1-ylcarbonylpyrrolidin-2-one
- (2S)-2-azanyl-N-[(2R)-1-[[(2S)-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-3-oxidanyl-propanamide
- (2R)-1-[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]-2-nitro-pyrrolidine-2-carboxylic acid
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- (2S)-N-[(2R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-5-azanyl-1-[(2S)-2-(ethylcarbamoyl)pyrrolidin-1-yl]-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-5-oxidanylidene-pyrrolidine-2-carboxamide
