8-[3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]prop-1-ynyl]-N-[(4-chlorophenyl)methyl]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: 8-[3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]prop-1-ynyl]-N-[(4-chlorophenyl)methyl]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-8-[3-(1,1-dioxo-1,4-thiazinan-4-yl)prop-1-ynyl]-1-methyl-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-8-[3-(1,1-dioxo-1,4-thiazinan-4-yl)prop-1-ynyl]-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-8-[3-(1,1-dioxo-1,4-thiazinan-4-yl)prop-1-ynyl]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-8-[3-(1,1-diketo-1,4-thiazinan-4-yl)prop-1-ynyl]-4-keto-1-methyl-6-(morpholinomethyl)cinnoline-3-carboxamide Formula: C29H32ClN5O5S MolecularWeight: 598.11288

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2C#CCN3CCS(=O)(=O)CC3)CN4CCOCC4)C(=O)C(=N1)C(=O)NCC5=CC=C(C=C5)Cl

Isomeric SMILES

CN1C2=C(C=C(C=C2C#CCN3CCS(=O)(=O)CC3)CN4CCOCC4)C(=O)C(=N1)C(=O)NCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H32ClN5O5S/c1-33-27-23(3-2-8-34-11-15-41(38,39)16-12-34)17-22(20-35-9-13-40-14-10-35)18-25(27)28(36)26(32-33)29(37)31-19-21-4-6-24(30)7-5-21/h4-7,17-18H,8-16,19-20H2,1H3,(H,31,37)