(3S,12aR)-3-thiophen-2-ylspiro[2,3,5,12a-tetrahydrobenzimidazolo[2,1-b]quinazoline-12,1'-cyclohexane]-1-one

Systemtic Name: (3S,12aR)-3-thiophen-2-ylspiro[2,3,5,12a-tetrahydrobenzimidazolo[2,1-b]quinazoline-12,1'-cyclohexane]-1-one Openeye Name: (3S,12aR)-3-(2-thienyl)spiro[2,3,5,12a-tetrahydrobenzimidazolo[2,1-b]quinazoline-12,1'-cyclohexane]-1-one CAS Name: (3S,12aR)-3-thiophen-2-yl-1-spiro[2,3,5,12a-tetrahydrobenzimidazolo[2,1-b]quinazoline-12,1'-cyclohexane]one IUPAC Name: (3S,12aR)-3-thiophen-2-ylspiro[2,3,5,12a-tetrahydrobenzimidazolo[2,1-b]quinazoline-12,1'-cyclohexane]-1-one Traditional Name: (3S,12aR)-3-(2-thienyl)spiro[2,3,5,12a-tetrahydrobenzimidazolo[2,1-b]quinazoline-12,1'-cyclohexane]-1-one Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C3C(=O)CC(C=C3NC4=NC5=CC=CC=C5N24)C6=CC=CS6

Isomeric SMILES

C1CCC2(CC1)[C@@H]3C(=O)C[C@@H](C=C3NC4=NC5=CC=CC=C5N24)C6=CC=CS6

InChI

InChI=1S/C23H23N3OS/c27-19-14-15(20-9-6-12-28-20)13-17-21(19)23(10-4-1-5-11-23)26-18-8-3-2-7-16(18)24-22(26)25-17/h2-3,6-9,12-13,15,21H,1,4-5,10-11,14H2,(H,24,25)/t15-,21+/m1/s1