N-[1-(4-bromophenyl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxidanylidene-prop-1-en-2-yl]-4-tert-butyl-benzamide

Systemtic Name: N-[1-(4-bromophenyl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxidanylidene-prop-1-en-2-yl]-4-tert-butyl-benzamide Openeye Name: N-[2-(4-bromophenyl)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]vinyl]-4-tert-butyl-benzamide CAS Name: N-[1-(4-bromophenyl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide IUPAC Name: N-[1-(4-bromophenyl)-3-[2-(1H-indol-3-yl)ethylamino]-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide Traditional Name: N-[2-(4-bromophenyl)-1-[2-(1H-indol-3-yl)ethylcarbamoyl]vinyl]-4-tert-butyl-benzamide Formula: C30H30BrN3O2 MolecularWeight: 544.4821

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C30H30BrN3O2/c1-30(2,3)23-12-10-21(11-13-23)28(35)34-27(18-20-8-14-24(31)15-9-20)29(36)32-17-16-22-19-33-26-7-5-4-6-25(22)26/h4-15,18-19,33H,16-17H2,1-3H3,(H,32,36)(H,34,35)