methyl 2-[[3-(5-ethanoyl-6-ethylsulfanyl-11-oxidanylidene-benzo[b]carbazol-11a-yl)propanoylamino]methyl]prop-2-enoate

Systemtic Name: methyl 2-[[3-(5-ethanoyl-6-ethylsulfanyl-11-oxidanylidene-benzo[b]carbazol-11a-yl)propanoylamino]methyl]prop-2-enoate Openeye Name: methyl 2-[[3-(5-acetyl-6-ethylsulfanyl-11-oxo-benzo[b]carbazol-11a-yl)propanoylamino]methyl]prop-2-enoate CAS Name: 2-[[[3-[5-acetyl-6-(ethylthio)-11-oxo-11a-benzo[b]carbazolyl]-1-oxopropyl]amino]methyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[[3-(5-acetyl-6-ethylsulfanyl-11-oxobenzo[b]carbazol-11a-yl)propanoylamino]methyl]prop-2-enoate Traditional Name: 2-[[3-[5-acetyl-6-(ethylthio)-11-keto-benzo[b]carbazol-11a-yl]propanoylamino]methyl]acrylic acid methyl ester Formula: C28H28N2O5S MolecularWeight: 504.59732

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C2C(C3=CC=CC=C3N2C(=O)C)(C(=O)C4=CC=CC=C41)CCC(=O)NCC(=C)C(=O)OC

Isomeric SMILES

CCSC1=C2C(C3=CC=CC=C3N2C(=O)C)(C(=O)C4=CC=CC=C41)CCC(=O)NCC(=C)C(=O)OC

InChI

InChI=1S/C28H28N2O5S/c1-5-36-24-19-10-6-7-11-20(19)26(33)28(15-14-23(32)29-16-17(2)27(34)35-4)21-12-8-9-13-22(21)30(18(3)31)25(24)28/h6-13H,2,5,14-16H2,1,3-4H3,(H,29,32)