N-cyclopentyl-4-oxidanylidene-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxamide

Systemtic Name: N-cyclopentyl-4-oxidanylidene-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxamide Openeye Name: N-cyclopentyl-4-oxo-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxamide CAS Name: N-cyclopentyl-4-oxo-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxamide IUPAC Name: N-cyclopentyl-4-oxo-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxamide Traditional Name: N-cyclopentyl-4-keto-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxamide Formula: C16H20N3O2S+ MolecularWeight: 318.4139

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CNC3=[N+](C2=O)C4=C(S3)CCCC4

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CNC3=[N+](C2=O)C4=C(S3)CCCC4

InChI

InChI=1S/C16H19N3O2S/c20-14(18-10-5-1-2-6-10)11-9-17-16-19(15(11)21)12-7-3-4-8-13(12)22-16/h9-10H,1-8H2,(H,18,20)/p+1