N-(2-ethoxyphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide CAS Name: N-(2-ethoxyphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)thio]acetamide IUPAC Name: N-(2-ethoxyphenyl)-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide Traditional Name: 2-[(8-methyl-5H-pyrimid[5,4-b]indol-4-yl)thio]-N-o-phenetyl-acetamide Formula: C21H20N4O2S MolecularWeight: 392.4741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSC2=NC=NC3=C2NC4=C3C=C(C=C4)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSC2=NC=NC3=C2NC4=C3C=C(C=C4)C

InChI

InChI=1S/C21H20N4O2S/c1-3-27-17-7-5-4-6-16(17)24-18(26)11-28-21-20-19(22-12-23-21)14-10-13(2)8-9-15(14)25-20/h4-10,12,25H,3,11H2,1-2H3,(H,24,26)