4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline

Systemtic Name: 4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline Openeye Name: 4-[4-[1-methyl-2-(3-methyl-2H-imidazol-1-yl)ethyl]-1,4-diazepan-1-yl]aniline CAS Name: 4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline IUPAC Name: 4-[4-[1-(3-methyl-2H-imidazol-1-yl)propan-2-yl]-1,4-diazepan-1-yl]aniline Traditional Name: [4-[4-[1-methyl-2-(3-methyl-4-imidazolin-1-yl)ethyl]-1,4-diazepan-1-yl]phenyl]amine Formula: C18H29N5 MolecularWeight: 315.45636

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CN(C=C1)C)N2CCCN(CC2)C3=CC=C(C=C3)N

Isomeric SMILES

CC(CN1CN(C=C1)C)N2CCCN(CC2)C3=CC=C(C=C3)N

InChI

InChI=1S/C18H29N5/c1-16(14-21-11-10-20(2)15-21)22-8-3-9-23(13-12-22)18-6-4-17(19)5-7-18/h4-7,10-11,16H,3,8-9,12-15,19H2,1-2H3