5-(4-chlorophenyl)carbonyl-2-(phenylmethyl)-4-[(phenylmethyl)amino]-1,2-thiazol-3-one

Systemtic Name: 5-(4-chlorophenyl)carbonyl-2-(phenylmethyl)-4-[(phenylmethyl)amino]-1,2-thiazol-3-one Openeye Name: 2-benzyl-4-(benzylamino)-5-(4-chlorobenzoyl)isothiazol-3-one CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-2-(phenylmethyl)-4-[(phenylmethyl)amino]-3-isothiazolone IUPAC Name: 2-benzyl-4-(benzylamino)-5-(4-chlorobenzoyl)-1,2-thiazol-3-one Traditional Name: 2-benzyl-4-(benzylamino)-5-(4-chlorobenzoyl)-4-isothiazolin-3-one Formula: C24H19ClN2O2S MolecularWeight: 434.93786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(SN(C2=O)CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(SN(C2=O)CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H19ClN2O2S/c25-20-13-11-19(12-14-20)22(28)23-21(26-15-17-7-3-1-4-8-17)24(29)27(30-23)16-18-9-5-2-6-10-18/h1-14,26H,15-16H2