2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(3-phenylpropyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(3-phenylpropyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(3-phenylpropyl)thiazole-5-carboxamide CAS Name: 2-[[(4-chloroanilino)-oxomethyl]amino]-4-methyl-N-(3-phenylpropyl)-5-thiazolecarboxamide IUPAC Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(3-phenylpropyl)-1,3-thiazole-5-carboxamide Traditional Name: 2-[(4-chlorophenyl)carbamoylamino]-4-methyl-N-(3-phenylpropyl)thiazole-5-carboxamide Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)NC2=CC=C(C=C2)Cl)C(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)NC2=CC=C(C=C2)Cl)C(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C21H21ClN4O2S/c1-14-18(19(27)23-13-5-8-15-6-3-2-4-7-15)29-21(24-14)26-20(28)25-17-11-9-16(22)10-12-17/h2-4,6-7,9-12H,5,8,13H2,1H3,(H,23,27)(H2,24,25,26,28)