7-nitro-5-phenyl-1-(propylsulfinylmethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-nitro-5-phenyl-1-(propylsulfinylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: 7-nitro-5-phenyl-1-(propylsulfinylmethyl)-3H-1,4-benzodiazepin-2-one CAS Name: 7-nitro-5-phenyl-1-(propylsulfinylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-nitro-5-phenyl-1-(propylsulfinylmethyl)-3H-1,4-benzodiazepin-2-one Traditional Name: 7-nitro-5-phenyl-1-(propylsulfinylmethyl)-3H-1,4-benzodiazepin-2-one Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCCS(=O)CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O4S/c1-2-10-27(26)13-21-17-9-8-15(22(24)25)11-16(17)19(20-12-18(21)23)14-6-4-3-5-7-14/h3-9,11H,2,10,12-13H2,1H3