3-(1H-indol-3-yl)-N-[4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-quinazolin-3-yl]propanamide

Systemtic Name: 3-(1H-indol-3-yl)-N-[4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-quinazolin-3-yl]propanamide Openeye Name: 3-(1H-indol-3-yl)-N-[4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-quinazolin-3-yl]propanamide CAS Name: 3-(1H-indol-3-yl)-N-[4-oxo-2-[[2-oxo-2-(phenethylamino)ethyl]thio]-3-quinazolinyl]propanamide IUPAC Name: 3-(1H-indol-3-yl)-N-[4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanylquinazolin-3-yl]propanamide Traditional Name: 3-(1H-indol-3-yl)-N-[4-keto-2-[[2-keto-2-(phenethylamino)ethyl]thio]quinazolin-3-yl]propionamide Formula: C29H27N5O3S MolecularWeight: 525.62138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2NC(=O)CCC4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2NC(=O)CCC4=CNC5=CC=CC=C54

InChI

InChI=1S/C29H27N5O3S/c35-26(15-14-21-18-31-24-12-6-4-10-22(21)24)33-34-28(37)23-11-5-7-13-25(23)32-29(34)38-19-27(36)30-17-16-20-8-2-1-3-9-20/h1-13,18,31H,14-17,19H2,(H,30,36)(H,33,35)