2-[3-(dimethylamino)propyl]-1-(2,6-dimethylphenyl)-3-(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)guanidine

Systemtic Name: 2-[3-(dimethylamino)propyl]-1-(2,6-dimethylphenyl)-3-(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)guanidine Openeye Name: 1-(7-benzyloxy-6-methoxy-quinazolin-4-yl)-2-[3-(dimethylamino)propyl]-3-(2,6-dimethylphenyl)guanidine CAS Name: 2-[3-(dimethylamino)propyl]-1-(2,6-dimethylphenyl)-3-(6-methoxy-7-phenylmethoxy-4-quinazolinyl)guanidine IUPAC Name: 2-[3-(dimethylamino)propyl]-1-(2,6-dimethylphenyl)-3-(6-methoxy-7-phenylmethoxyquinazolin-4-yl)guanidine Traditional Name: 1-(7-benzoxy-6-methoxy-quinazolin-4-yl)-2-[3-(dimethylamino)propyl]-3-(2,6-dimethylphenyl)guanidine Formula: C30H36N6O2 MolecularWeight: 512.64584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=NCCCN(C)C)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=NCCCN(C)C)NC2=NC=NC3=CC(=C(C=C32)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C30H36N6O2/c1-21-11-9-12-22(2)28(21)34-30(31-15-10-16-36(3)4)35-29-24-17-26(37-5)27(18-25(24)32-20-33-29)38-19-23-13-7-6-8-14-23/h6-9,11-14,17-18,20H,10,15-16,19H2,1-5H3,(H2,31,32,33,34,35)