7-chloranyl-1-(ethylsulfonylmethyl)-5-(2-methylphenyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(ethylsulfonylmethyl)-5-(2-methylphenyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(ethylsulfonylmethyl)-5-(o-tolyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(ethylsulfonylmethyl)-5-(2-methylphenyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(ethylsulfonylmethyl)-5-(2-methylphenyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(esylmethyl)-5-(o-tolyl)-3H-1,4-benzodiazepin-2-one Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3C

Isomeric SMILES

CCS(=O)(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3C

InChI

InChI=1S/C19H19ClN2O3S/c1-3-26(24,25)12-22-17-9-8-14(20)10-16(17)19(21-11-18(22)23)15-7-5-4-6-13(15)2/h4-10H,3,11-12H2,1-2H3