N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[[4-(indolin-1-ylmethyl)phenyl]methyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[4-(indolin-1-ylmethyl)benzyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C27H26N4O2S MolecularWeight: 470.58594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)CNC(=O)CCN4C(=O)C5=CC=CC=C5NC4=S

Isomeric SMILES

C1CN(C2=CC=CC=C21)CC3=CC=C(C=C3)CNC(=O)CCN4C(=O)C5=CC=CC=C5NC4=S

InChI

InChI=1S/C27H26N4O2S/c32-25(14-16-31-26(33)22-6-2-3-7-23(22)29-27(31)34)28-17-19-9-11-20(12-10-19)18-30-15-13-21-5-1-4-8-24(21)30/h1-12H,13-18H2,(H,28,32)(H,29,34)