2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-[(2,4-dimethylanilino)-oxomethyl]propanamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-[(2,4-dimethylphenyl)carbamoyl]propanamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-[(2,4-dimethylphenyl)carbamoyl]propionamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC(=CN2N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C(C)SC2=NC(=CN2N)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23N5O2S/c1-13-9-10-17(14(2)11-13)23-20(28)25-19(27)15(3)29-21-24-18(12-26(21)22)16-7-5-4-6-8-16/h4-12,15H,22H2,1-3H3,(H2,23,25,27,28)