8-chloranyl-4-[3-[5-[(cyclopropylamino)methyl]-1,2,3-triazol-1-yl]phenyl]-7-[methyl(propan-2-yl)amino]-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 8-chloranyl-4-[3-[5-[(cyclopropylamino)methyl]-1,2,3-triazol-1-yl]phenyl]-7-[methyl(propan-2-yl)amino]-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 8-chloro-4-[3-[5-[(cyclopropylamino)methyl]triazol-1-yl]phenyl]-7-[isopropyl(methyl)amino]-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 8-chloro-4-[3-[5-[(cyclopropylamino)methyl]-1-triazolyl]phenyl]-7-[methyl(propan-2-yl)amino]-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 8-chloro-4-[3-[5-[(cyclopropylamino)methyl]triazol-1-yl]phenyl]-7-[methyl(propan-2-yl)amino]-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 8-chloro-4-[3-[5-[(cyclopropylamino)methyl]triazol-1-yl]phenyl]-7-[isopropyl(methyl)amino]-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C25H28ClN7O MolecularWeight: 477.98912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)C1=C(C=C2C(=C1)N=C(CC(=O)N2)C3=CC(=CC=C3)N4C(=CN=N4)CNC5CC5)Cl

Isomeric SMILES

CC(C)N(C)C1=C(C=C2C(=C1)N=C(CC(=O)N2)C3=CC(=CC=C3)N4C(=CN=N4)CNC5CC5)Cl

InChI

InChI=1S/C25H28ClN7O/c1-15(2)32(3)24-11-23-22(10-20(24)26)30-25(34)12-21(29-23)16-5-4-6-18(9-16)33-19(14-28-31-33)13-27-17-7-8-17/h4-6,9-11,14-15,17,27H,7-8,12-13H2,1-3H3,(H,30,34)