3-bromanyl-N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-bromanyl-N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-bromo-N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]benzamide CAS Name: 3-bromo-N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide IUPAC Name: 3-bromo-N-cyclopropyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide Traditional Name: 3-bromo-N-cyclopropyl-N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]benzamide Formula: C27H29BrN2O4S MolecularWeight: 557.49916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC=CS2)C(=O)CN(C3CC3)C(=O)C4=CC(=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC=CS2)C(=O)CN(C3CC3)C(=O)C4=CC(=CC=C4)Br)OC

InChI

InChI=1S/C27H29BrN2O4S/c1-33-24-11-8-19(15-25(24)34-2)12-13-29(17-23-7-4-14-35-23)26(31)18-30(22-9-10-22)27(32)20-5-3-6-21(28)16-20/h3-8,11,14-16,22H,9-10,12-13,17-18H2,1-2H3