4-azanyl-5-(3-bromophenyl)carbonyl-N-(2,4-dimethylphenyl)-2-(propylamino)thiophene-3-carboxamide

Systemtic Name: 4-azanyl-5-(3-bromophenyl)carbonyl-N-(2,4-dimethylphenyl)-2-(propylamino)thiophene-3-carboxamide Openeye Name: 4-amino-5-(3-bromobenzoyl)-N-(2,4-dimethylphenyl)-2-(propylamino)thiophene-3-carboxamide CAS Name: 4-amino-5-[(3-bromophenyl)-oxomethyl]-N-(2,4-dimethylphenyl)-2-(propylamino)-3-thiophenecarboxamide IUPAC Name: 4-amino-5-(3-bromobenzoyl)-N-(2,4-dimethylphenyl)-2-(propylamino)thiophene-3-carboxamide Traditional Name: 4-amino-5-(3-bromobenzoyl)-N-(2,4-dimethylphenyl)-2-(propylamino)thiophene-3-carboxamide Formula: C23H24BrN3O2S MolecularWeight: 486.42456

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C(=C(S1)C(=O)C2=CC(=CC=C2)Br)N)C(=O)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCNC1=C(C(=C(S1)C(=O)C2=CC(=CC=C2)Br)N)C(=O)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C23H24BrN3O2S/c1-4-10-26-23-18(22(29)27-17-9-8-13(2)11-14(17)3)19(25)21(30-23)20(28)15-6-5-7-16(24)12-15/h5-9,11-12,26H,4,10,25H2,1-3H3,(H,27,29)