N-[(Z)-3-(azepan-1-yl)-1-(4-bromophenyl)-3-oxidanylidene-prop-1-en-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(Z)-3-(azepan-1-yl)-1-(4-bromophenyl)-3-oxidanylidene-prop-1-en-2-yl]thiophene-2-carboxamide Openeye Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-bromophenyl)vinyl]thiophene-2-carboxamide CAS Name: N-[(Z)-3-(1-azepanyl)-1-(4-bromophenyl)-3-oxoprop-1-en-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(Z)-3-(azepan-1-yl)-1-(4-bromophenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide Traditional Name: N-[(Z)-1-(azepane-1-carbonyl)-2-(4-bromophenyl)vinyl]thiophene-2-carboxamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=CC2=CC=C(C=C2)Br)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)C(=O)/C(=C/C2=CC=C(C=C2)Br)/NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H21BrN2O2S/c21-16-9-7-15(8-10-16)14-17(22-19(24)18-6-5-13-26-18)20(25)23-11-3-1-2-4-12-23/h5-10,13-14H,1-4,11-12H2,(H,22,24)/b17-14-