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

Systemtic Name: 2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]acetamide CAS Name: 2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)thio]-N-propan-2-ylacetamide IUPAC Name: 2-[(8-methyl-5H-pyrimido[5,4-b]indol-4-yl)sulfanyl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[(8-methyl-5H-pyrimid[5,4-b]indol-4-yl)thio]acetamide Formula: C16H18N4OS MolecularWeight: 314.40532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=C2N=CN=C3SCC(=O)NC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=C2N=CN=C3SCC(=O)NC(C)C

InChI

InChI=1S/C16H18N4OS/c1-9(2)19-13(21)7-22-16-15-14(17-8-18-16)11-6-10(3)4-5-12(11)20-15/h4-6,8-9,20H,7H2,1-3H3,(H,19,21)