2-[2-[[(S)-(4-methylphenyl)-phenyl-methyl]amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[[(S)-(4-methylphenyl)-phenyl-methyl]amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[[(S)-phenyl(p-tolyl)methyl]amino]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[[(S)-phenyl(p-tolyl)methyl]amino]acetyl]amino]thiophene-3-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NCC(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NCC(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C21H21N3O2S/c1-14-7-9-16(10-8-14)19(15-5-3-2-4-6-15)23-13-18(25)24-21-17(20(22)26)11-12-27-21/h2-12,19,23H,13H2,1H3,(H2,22,26)(H,24,25)/t19-/m0/s1