2-[[3-(4-ethoxyphenyl)-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[3-(4-ethoxyphenyl)-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-(1-naphthyl)acetamide CAS Name: 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[3-(4-ethoxyphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[(4-keto-3-p-phenetyl-5H-pyrimid[5,4-b]indol-2-yl)thio]-N-(1-naphthyl)acetamide Formula: C30H24N4O3S MolecularWeight: 520.60156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C30H24N4O3S/c1-2-37-21-16-14-20(15-17-21)34-29(36)28-27(23-11-5-6-12-25(23)32-28)33-30(34)38-18-26(35)31-24-13-7-9-19-8-3-4-10-22(19)24/h3-17,32H,2,18H2,1H3,(H,31,35)