methyl N-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamate

Systemtic Name: methyl N-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: methyl N-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamate CAS Name: N-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamate Traditional Name: N-[5-(3-butoxyphenyl)-1,3,4-thiadiazol-2-yl]carbamic acid methyl ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)OC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)OC

InChI

InChI=1S/C14H17N3O3S/c1-3-4-8-20-11-7-5-6-10(9-11)12-16-17-13(21-12)15-14(18)19-2/h5-7,9H,3-4,8H2,1-2H3,(H,15,17,18)