[1-(4-aminophenyl)-7-bromanyl-8-methoxy-4-methyl-2,3-benzodiazepin-3-yl]-cyclopropyl-methanone

Systemtic Name: [1-(4-aminophenyl)-7-bromanyl-8-methoxy-4-methyl-2,3-benzodiazepin-3-yl]-cyclopropyl-methanone Openeye Name: [1-(4-aminophenyl)-7-bromo-8-methoxy-4-methyl-2,3-benzodiazepin-3-yl]-cyclopropyl-methanone CAS Name: [1-(4-aminophenyl)-7-bromo-8-methoxy-4-methyl-2,3-benzodiazepin-3-yl]-cyclopropylmethanone IUPAC Name: [1-(4-aminophenyl)-7-bromo-8-methoxy-4-methyl-2,3-benzodiazepin-3-yl]-cyclopropylmethanone Traditional Name: [1-(4-aminophenyl)-7-bromo-8-methoxy-4-methyl-2,3-benzodiazepin-3-yl]-cyclopropyl-methanone Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2C(=NN1C(=O)C3CC3)C4=CC=C(C=C4)N)OC)Br

Isomeric SMILES

CC1=CC2=CC(=C(C=C2C(=NN1C(=O)C3CC3)C4=CC=C(C=C4)N)OC)Br

InChI

InChI=1S/C21H20BrN3O2/c1-12-9-15-10-18(22)19(27-2)11-17(15)20(13-5-7-16(23)8-6-13)24-25(12)21(26)14-3-4-14/h5-11,14H,3-4,23H2,1-2H3