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

Systemtic Name: 7-chloranyl-5-(2-methylphenyl)-1-(methylsulfonylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(methylsulfonylmethyl)-5-(o-tolyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-5-(2-methylphenyl)-1-(methylsulfonylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(2-methylphenyl)-1-(methylsulfonylmethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(mesylmethyl)-5-(o-tolyl)-3H-1,4-benzodiazepin-2-one Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NCC(=O)N(C3=C2C=C(C=C3)Cl)CS(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1C2=NCC(=O)N(C3=C2C=C(C=C3)Cl)CS(=O)(=O)C

InChI

InChI=1S/C18H17ClN2O3S/c1-12-5-3-4-6-14(12)18-15-9-13(19)7-8-16(15)21(11-25(2,23)24)17(22)10-20-18/h3-9H,10-11H2,1-2H3