2-[[(2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoyl]amino]thiophene-3-carboxamide

Systemtic Name: 2-[[(2S)-3-methyl-2-[(4-methylphenyl)carbonylamino]butanoyl]amino]thiophene-3-carboxamide Openeye Name: 2-[[(2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoyl]amino]thiophene-3-carboxamide CAS Name: 2-[[(2S)-3-methyl-2-[[(4-methylphenyl)-oxomethyl]amino]-1-oxobutyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[(2S)-3-methyl-2-[(4-methylbenzoyl)amino]butanoyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[(2S)-3-methyl-2-(p-toluoylamino)butanoyl]amino]thiophene-3-carboxamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C18H21N3O3S/c1-10(2)14(20-16(23)12-6-4-11(3)5-7-12)17(24)21-18-13(15(19)22)8-9-25-18/h4-10,14H,1-3H3,(H2,19,22)(H,20,23)(H,21,24)/t14-/m0/s1