2-cyclopentyl-1,1-bis(oxidanylidene)-5-phenyl-4-[(phenylmethyl)amino]-1,2-thiazol-3-one

Systemtic Name: 2-cyclopentyl-1,1-bis(oxidanylidene)-5-phenyl-4-[(phenylmethyl)amino]-1,2-thiazol-3-one Openeye Name: 4-(benzylamino)-2-cyclopentyl-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-cyclopentyl-1,1-dioxo-5-phenyl-4-[(phenylmethyl)amino]-3-isothiazolone IUPAC Name: 4-(benzylamino)-2-cyclopentyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 4-(benzylamino)-2-cyclopentyl-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C(=C(S2(=O)=O)C3=CC=CC=C3)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)N2C(=O)C(=C(S2(=O)=O)C3=CC=CC=C3)NCC4=CC=CC=C4

InChI

InChI=1S/C21H22N2O3S/c24-21-19(22-15-16-9-3-1-4-10-16)20(17-11-5-2-6-12-17)27(25,26)23(21)18-13-7-8-14-18/h1-6,9-12,18,22H,7-8,13-15H2