(2R)-2-phenyl-2-[(4-thiophen-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]ethanoate

Systemtic Name: (2R)-2-phenyl-2-[(4-thiophen-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]ethanoate Openeye Name: (2R)-2-phenyl-2-[[4-(2-thienyl)-5,6,7,8-tetrahydroquinazolin-2-yl]sulfanyl]acetate CAS Name: (2R)-2-phenyl-2-[(4-thiophen-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)thio]acetate IUPAC Name: (2R)-2-phenyl-2-[(4-thiophen-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)sulfanyl]acetate Traditional Name: (2R)-2-phenyl-2-[[4-(2-thienyl)-5,6,7,8-tetrahydroquinazolin-2-yl]thio]acetate Formula: C20H17N2O2S2- MolecularWeight: 381.49118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC(=NC(=C2C1)C3=CC=CS3)SC(C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1CCC2=NC(=NC(=C2C1)C3=CC=CS3)S[C@H](C4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C20H18N2O2S2/c23-19(24)18(13-7-2-1-3-8-13)26-20-21-15-10-5-4-9-14(15)17(22-20)16-11-6-12-25-16/h1-3,6-8,11-12,18H,4-5,9-10H2,(H,23,24)/p-1/t18-/m1/s1