1-(3,4-dichlorophenyl)-2-[4-methyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-yl]guanidine

Systemtic Name: 1-(3,4-dichlorophenyl)-2-[4-methyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-yl]guanidine Openeye Name: 1-(3,4-dichlorophenyl)-2-[4-methyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-yl]guanidine CAS Name: 1-(3,4-dichlorophenyl)-2-[4-methyl-6-(4-methyl-1,4-diazepan-1-yl)-2-pyrimidinyl]guanidine IUPAC Name: 1-(3,4-dichlorophenyl)-2-[4-methyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-yl]guanidine Traditional Name: 1-(3,4-dichlorophenyl)-2-[4-methyl-6-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-yl]guanidine Formula: C18H23Cl2N7 MolecularWeight: 408.32812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C(N)NC2=CC(=C(C=C2)Cl)Cl)N3CCCN(CC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N=C(N)NC2=CC(=C(C=C2)Cl)Cl)N3CCCN(CC3)C

InChI

InChI=1S/C18H23Cl2N7/c1-12-10-16(27-7-3-6-26(2)8-9-27)24-18(22-12)25-17(21)23-13-4-5-14(19)15(20)11-13/h4-5,10-11H,3,6-9H2,1-2H3,(H3,21,22,23,24,25)