N-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]-1,4,4a,8a-tetrahydroquinazolin-2-amine

Systemtic Name: N-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]-1,4,4a,8a-tetrahydroquinazolin-2-amine Openeye Name: N-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]-1,4,4a,8a-tetrahydroquinazolin-2-amine CAS Name: N-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]-1,4,4a,8a-tetrahydroquinazolin-2-amine IUPAC Name: N-(3-bromophenyl)-7-[4-(dimethylamino)butoxy]-1,4,4a,8a-tetrahydroquinazolin-2-amine Traditional Name: 4-[[2-(3-bromoanilino)-1,4,4a,8a-tetrahydroquinazolin-7-yl]oxy]butyl-dimethyl-amine Formula: C20H27BrN4O MolecularWeight: 419.35858

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCOC1=CC2C(CN=C(N2)NC3=CC(=CC=C3)Br)C=C1

Isomeric SMILES

CN(C)CCCCOC1=CC2C(CN=C(N2)NC3=CC(=CC=C3)Br)C=C1

InChI

InChI=1S/C20H27BrN4O/c1-25(2)10-3-4-11-26-18-9-8-15-14-22-20(24-19(15)13-18)23-17-7-5-6-16(21)12-17/h5-9,12-13,15,19H,3-4,10-11,14H2,1-2H3,(H2,22,23,24)