4,5-dimethyl-2-[2-[phenylcarbamoyl(thiophen-2-ylmethyl)amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 4,5-dimethyl-2-[2-[phenylcarbamoyl(thiophen-2-ylmethyl)amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 4,5-dimethyl-2-[[2-[phenylcarbamoyl(2-thienylmethyl)amino]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[[anilino(oxo)methyl]-(thiophen-2-ylmethyl)amino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 4,5-dimethyl-2-[[2-[phenylcarbamoyl(thiophen-2-ylmethyl)amino]acetyl]amino]thiophene-3-carboxamide Traditional Name: 4,5-dimethyl-2-[[2-[phenylcarbamoyl(2-thenyl)amino]acetyl]amino]thiophene-3-carboxamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)CN(CC2=CC=CS2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)CN(CC2=CC=CS2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O3S2/c1-13-14(2)30-20(18(13)19(22)27)24-17(26)12-25(11-16-9-6-10-29-16)21(28)23-15-7-4-3-5-8-15/h3-10H,11-12H2,1-2H3,(H2,22,27)(H,23,28)(H,24,26)