1-(4-butyl-2-methyl-phenyl)-2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine

Systemtic Name: 1-(4-butyl-2-methyl-phenyl)-2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine Openeye Name: 1-(4-butyl-2-methyl-phenyl)-2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine CAS Name: 1-(4-butyl-2-methylphenyl)-2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine IUPAC Name: 1-(4-butyl-2-methylphenyl)-2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine Traditional Name: 1-(4-butyl-2-methyl-phenyl)-2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)guanidine Formula: C21H29N5 MolecularWeight: 351.48846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=NC2=NC3=C(CCCC3)C(=N2)C)N)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)N/C(=N/C2=NC3=C(CCCC3)C(=N2)C)/N)C

InChI

InChI=1S/C21H29N5/c1-4-5-8-16-11-12-18(14(2)13-16)24-20(22)26-21-23-15(3)17-9-6-7-10-19(17)25-21/h11-13H,4-10H2,1-3H3,(H3,22,23,24,25,26)