4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-keto-4-(3-phenyl-2-pyrazolin-1-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butyramide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2S/c25-18(22-20-21-16-8-4-5-9-17(16)27-20)10-11-19(26)24-13-12-15(23-24)14-6-2-1-3-7-14/h1-3,6-7H,4-5,8-13H2,(H,21,22,25)