2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyethyl)-N-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 2-[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methoxyethyl)-N-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[2-(1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-N-isobutyl-3-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[[2-(1H-indol-3-yl)-2-oxoethyl]thio]-3-(2-methoxyethyl)-N-(2-methylpropyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[2-(1H-indol-3-yl)-2-oxoethyl]sulfanyl-3-(2-methoxyethyl)-N-(2-methylpropyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[[2-(1H-indol-3-yl)-2-keto-ethyl]thio]-N-isobutyl-4-keto-3-(2-methoxyethyl)quinazoline-7-carboxamide Formula: C26H28N4O4S MolecularWeight: 492.58992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)C3=CNC4=CC=CC=C43)CCOC

Isomeric SMILES

CC(C)CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)C3=CNC4=CC=CC=C43)CCOC

InChI

InChI=1S/C26H28N4O4S/c1-16(2)13-28-24(32)17-8-9-19-22(12-17)29-26(30(25(19)33)10-11-34-3)35-15-23(31)20-14-27-21-7-5-4-6-18(20)21/h4-9,12,14,16,27H,10-11,13,15H2,1-3H3,(H,28,32)