4-[[(2S)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-N-(2-methoxyphenyl)benzamide

Systemtic Name: 4-[[(2S)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoyl]amino]-N-(2-methoxyphenyl)benzamide Openeye Name: N-(2-methoxyphenyl)-4-[[(2S)-4-methylsulfanyl-2-ureido-butanoyl]amino]benzamide CAS Name: 4-[[(2S)-2-(carbamoylamino)-4-(methylthio)-1-oxobutyl]amino]-N-(2-methoxyphenyl)benzamide IUPAC Name: 4-[[(2S)-2-(carbamoylamino)-4-methylsulfanylbutanoyl]amino]-N-(2-methoxyphenyl)benzamide Traditional Name: N-(2-methoxyphenyl)-4-[[(2S)-4-(methylthio)-2-ureido-butanoyl]amino]benzamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)C(CCSC)NC(=O)N

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)[C@H](CCSC)NC(=O)N

InChI

InChI=1S/C20H24N4O4S/c1-28-17-6-4-3-5-15(17)23-18(25)13-7-9-14(10-8-13)22-19(26)16(11-12-29-2)24-20(21)27/h3-10,16H,11-12H2,1-2H3,(H,22,26)(H,23,25)(H3,21,24,27)/t16-/m0/s1