(7S,11S)-10-azanyl-8-oxidanylidene-11-(4-phenyl-1,3-thiazol-2-yl)-9-azaspiro[5.5]undec-9-ene-7-carbonitrile

Systemtic Name: (7S,11S)-10-azanyl-8-oxidanylidene-11-(4-phenyl-1,3-thiazol-2-yl)-9-azaspiro[5.5]undec-9-ene-7-carbonitrile Openeye Name: (7S,11S)-10-amino-8-oxo-11-(4-phenylthiazol-2-yl)-9-azaspiro[5.5]undec-9-ene-7-carbonitrile CAS Name: (7S,11S)-10-amino-8-oxo-11-(4-phenyl-2-thiazolyl)-9-azaspiro[5.5]undec-9-ene-7-carbonitrile IUPAC Name: (7S,11S)-10-amino-8-oxo-11-(4-phenyl-1,3-thiazol-2-yl)-9-azaspiro[5.5]undec-9-ene-7-carbonitrile Traditional Name: (7S,11S)-10-amino-8-keto-11-(4-phenylthiazol-2-yl)-9-azaspiro[5.5]undec-9-ene-7-carbonitrile Formula: C20H20N4OS MolecularWeight: 364.464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(=O)N=C(C2C3=NC(=CS3)C4=CC=CC=C4)N)C#N

Isomeric SMILES

C1CCC2(CC1)[C@H](C(=O)N=C([C@H]2C3=NC(=CS3)C4=CC=CC=C4)N)C#N

InChI

InChI=1S/C20H20N4OS/c21-11-14-18(25)24-17(22)16(20(14)9-5-2-6-10-20)19-23-15(12-26-19)13-7-3-1-4-8-13/h1,3-4,7-8,12,14,16H,2,5-6,9-10H2,(H2,22,24,25)/t14-,16-/m0/s1