N-(4-ethoxyphenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)ethanamide Openeye Name: N-(4-ethoxyphenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)acetamide CAS Name: N-(4-ethoxyphenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylthio)acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-(5H-pyrimido[5,4-b]indol-4-ylsulfanyl)acetamide Traditional Name: N-p-phenetyl-2-(5H-pyrimid[5,4-b]indol-4-ylthio)acetamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2NC4=CC=CC=C43

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CSC2=NC=NC3=C2NC4=CC=CC=C43

InChI

InChI=1S/C20H18N4O2S/c1-2-26-14-9-7-13(8-10-14)23-17(25)11-27-20-19-18(21-12-22-20)15-5-3-4-6-16(15)24-19/h3-10,12,24H,2,11H2,1H3,(H,23,25)