N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine

Systemtic Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine Openeye Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine CAS Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine IUPAC Name: N-butyl-7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-amine Traditional Name: butyl-(7-phenyl-2,3-dihydro-1H-1,4-diazepin-5-yl)amine Formula: C15H21N3 MolecularWeight: 243.34734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NCCNC(=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCNC1=NCCNC(=C1)C2=CC=CC=C2

InChI

InChI=1S/C15H21N3/c1-2-3-9-17-15-12-14(16-10-11-18-15)13-7-5-4-6-8-13/h4-8,12,16H,2-3,9-11H2,1H3,(H,17,18)