N-cycloheptyl-7-methoxy-1-oxidanylidene-3-phenyl-2-(thiophen-2-ylmethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide

Systemtic Name: N-cycloheptyl-7-methoxy-1-oxidanylidene-3-phenyl-2-(thiophen-2-ylmethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide Openeye Name: N-cycloheptyl-7-methoxy-1-oxo-3-phenyl-2-(2-thienylmethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide CAS Name: N-cycloheptyl-7-methoxy-1-oxo-3-phenyl-2-(thiophen-2-ylmethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide IUPAC Name: N-cycloheptyl-7-methoxy-1-oxo-3-phenyl-2-(thiophen-2-ylmethyl)-4H-pyrazino[1,2-a]indole-3-carboxamide Traditional Name: N-cycloheptyl-1-keto-7-methoxy-3-phenyl-2-(2-thenyl)-4H-pyrazin[1,2-a]indole-3-carboxamide Formula: C31H33N3O3S MolecularWeight: 527.67702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C3N2CC(N(C3=O)CC4=CC=CS4)(C5=CC=CC=C5)C(=O)NC6CCCCCC6

Isomeric SMILES

COC1=CC2=C(C=C1)C=C3N2CC(N(C3=O)CC4=CC=CS4)(C5=CC=CC=C5)C(=O)NC6CCCCCC6

InChI

InChI=1S/C31H33N3O3S/c1-37-25-16-15-22-18-28-29(35)34(20-26-14-9-17-38-26)31(21-33(28)27(22)19-25,23-10-5-4-6-11-23)30(36)32-24-12-7-2-3-8-13-24/h4-6,9-11,14-19,24H,2-3,7-8,12-13,20-21H2,1H3,(H,32,36)