methyl 2-[bis(methylsulfanyl)methyl]-3-[3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-methyl-4H-pyridin-4-yl]indole-1-carboxylate

Systemtic Name: methyl 2-[bis(methylsulfanyl)methyl]-3-[3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-methyl-4H-pyridin-4-yl]indole-1-carboxylate Openeye Name: methyl 2-[bis(methylsulfanyl)methyl]-3-[3-[(E)-3-methoxy-3-oxo-prop-1-enyl]-1-methyl-4H-pyridin-4-yl]indole-1-carboxylate CAS Name: 2-[bis(methylthio)methyl]-3-[3-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-methyl-4H-pyridin-4-yl]-1-indolecarboxylic acid methyl ester IUPAC Name: methyl 2-[bis(methylsulfanyl)methyl]-3-[3-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-methyl-4H-pyridin-4-yl]indole-1-carboxylate Traditional Name: 2-[bis(methylthio)methyl]-3-[3-[(E)-3-keto-3-methoxy-prop-1-enyl]-1-methyl-4H-pyridin-4-yl]indole-1-carboxylic acid methyl ester Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(C(=C1)C=CC(=O)OC)C2=C(N(C3=CC=CC=C32)C(=O)OC)C(SC)SC

Isomeric SMILES

CN1C=CC(C(=C1)/C=C/C(=O)OC)C2=C(N(C3=CC=CC=C32)C(=O)OC)C(SC)SC

InChI

InChI=1S/C23H26N2O4S2/c1-24-13-12-16(15(14-24)10-11-19(26)28-2)20-17-8-6-7-9-18(17)25(23(27)29-3)21(20)22(30-4)31-5/h6-14,16,22H,1-5H3/b11-10+