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

Systemtic Name: 2-[(3-methyl-4-oxidanylidene-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[(3-methyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-thiazol-2-yl-acetamide CAS Name: 2-[(3-methyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)thio]-N-(2-thiazolyl)acetamide IUPAC Name: 2-[(3-methyl-4-oxo-5H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(4-keto-3-methyl-5H-pyrimid[5,4-b]indol-2-yl)thio]-N-thiazol-2-yl-acetamide Formula: C16H13N5O2S2 MolecularWeight: 371.43672

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)NC4=NC=CS4

Isomeric SMILES

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)NC4=NC=CS4

InChI

InChI=1S/C16H13N5O2S2/c1-21-14(23)13-12(9-4-2-3-5-10(9)18-13)20-16(21)25-8-11(22)19-15-17-6-7-24-15/h2-7,18H,8H2,1H3,(H,17,19,22)