7-chloranyl-N-[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxamide

Systemtic Name: 7-chloranyl-N-[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxamide Openeye Name: 7-chloro-N-[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxamide CAS Name: 7-chloro-N-[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxamide IUPAC Name: 7-chloro-N-[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxamide Traditional Name: 7-chloro-N-[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]-3,5-dihydro-2H-1,4-benzoxazepine-4-carboxamide Formula: C19H18ClN5O2 MolecularWeight: 383.83152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=NN2)NC(=O)N3CCOC4=C(C3)C=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=NN2)NC(=O)N3CCOC4=C(C3)C=C(C=C4)Cl

InChI

InChI=1S/C19H18ClN5O2/c1-12-3-2-4-13(9-12)17-21-18(24-23-17)22-19(26)25-7-8-27-16-6-5-15(20)10-14(16)11-25/h2-6,9-10H,7-8,11H2,1H3,(H2,21,22,23,24,26)