methyl 2-(dimethylcarbamothioyloxy)-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoate

Systemtic Name: methyl 2-(dimethylcarbamothioyloxy)-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoate Openeye Name: methyl 2-(dimethylcarbamothioyloxy)-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoate CAS Name: 2-[dimethylamino(sulfanylidene)methoxy]-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid methyl ester IUPAC Name: methyl 2-(dimethylcarbamothioyloxy)-5-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoate Traditional Name: 2-(dimethylthiocarbamoyloxy)-5-(2-phenyl-4,5-dihydrobenz[e]indol-3-yl)benzoic acid methyl ester Formula: C29H26N2O3S MolecularWeight: 482.59334

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)OC1=C(C=C(C=C1)N2C3=C(C=C2C4=CC=CC=C4)C5=CC=CC=C5CC3)C(=O)OC

Isomeric SMILES

CN(C)C(=S)OC1=C(C=C(C=C1)N2C3=C(C=C2C4=CC=CC=C4)C5=CC=CC=C5CC3)C(=O)OC

InChI

InChI=1S/C29H26N2O3S/c1-30(2)29(35)34-27-16-14-21(17-24(27)28(32)33-3)31-25-15-13-19-9-7-8-12-22(19)23(25)18-26(31)20-10-5-4-6-11-20/h4-12,14,16-18H,13,15H2,1-3H3