4-[[2-ethoxy-4-[(4-methylpiperazin-1-yl)methyl]cyclohexa-1,3-dien-1-yl]amino]benzenecarboximidamide

Systemtic Name: 4-[[2-ethoxy-4-[(4-methylpiperazin-1-yl)methyl]cyclohexa-1,3-dien-1-yl]amino]benzenecarboximidamide Openeye Name: 4-[[2-ethoxy-4-[(4-methylpiperazin-1-yl)methyl]cyclohexa-1,3-dien-1-yl]amino]benzamidine CAS Name: 4-[[2-ethoxy-4-[(4-methyl-1-piperazinyl)methyl]-1-cyclohexa-1,3-dienyl]amino]benzenecarboximidamide IUPAC Name: 4-[[2-ethoxy-4-[(4-methylpiperazin-1-yl)methyl]cyclohexa-1,3-dien-1-yl]amino]benzenecarboximidamide Traditional Name: 4-[[2-ethoxy-4-[(4-methylpiperazino)methyl]cyclohexa-1,3-dien-1-yl]amino]benzamidine Formula: C21H31N5O MolecularWeight: 369.50374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(CCC(=C1)CN2CCN(CC2)C)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC1=C(CCC(=C1)CN2CCN(CC2)C)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H31N5O/c1-3-27-20-14-16(15-26-12-10-25(2)11-13-26)4-9-19(20)24-18-7-5-17(6-8-18)21(22)23/h5-8,14,24H,3-4,9-13,15H2,1-2H3,(H3,22,23)