N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-[(phenylmethyl)amino]-1,3-thiazole-5-carboxamide

Systemtic Name: N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]-2-[(phenylmethyl)amino]-1,3-thiazole-5-carboxamide Openeye Name: 2-(benzylamino)-N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]thiazole-5-carboxamide CAS Name: N-[5-[(cyclopropylamino)-oxomethyl]-2-methylphenyl]-2-[(phenylmethyl)amino]-5-thiazolecarboxamide IUPAC Name: 2-(benzylamino)-N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-(benzylamino)-N-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]thiazole-5-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC(=O)C3=CN=C(S3)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)NC(=O)C3=CN=C(S3)NCC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2S/c1-14-7-8-16(20(27)25-17-9-10-17)11-18(14)26-21(28)19-13-24-22(29-19)23-12-15-5-3-2-4-6-15/h2-8,11,13,17H,9-10,12H2,1H3,(H,23,24)(H,25,27)(H,26,28)