N-(3-chlorophenyl)-6,7-dimethyl-quinazolin-4-amine; 6,7-dimethoxy-4-naphthalen-2-ylsulfonyl-quinazoline; hydrochloride

Systemtic Name: N-(3-chlorophenyl)-6,7-dimethyl-quinazolin-4-amine; 6,7-dimethoxy-4-naphthalen-2-ylsulfonyl-quinazoline; hydrochloride Openeye Name: N-(3-chlorophenyl)-6,7-dimethyl-quinazolin-4-amine; 6,7-dimethoxy-4-(2-naphthylsulfonyl)quinazoline; hydrochloride CAS Name: N-(3-chlorophenyl)-6,7-dimethyl-4-quinazolinamine; 6,7-dimethoxy-4-(2-naphthalenylsulfonyl)quinazoline; hydrochloride IUPAC Name: N-(3-chlorophenyl)-6,7-dimethylquinazolin-4-amine; 6,7-dimethoxy-4-naphthalen-2-ylsulfonylquinazoline; hydrochloride Traditional Name: (3-chlorophenyl)-(6,7-dimethylquinazolin-4-yl)amine; 6,7-dimethoxy-4-(2-naphthylsulfonyl)quinazoline; hydrochloride Formula: C36H31Cl2N5O4S MolecularWeight: 700.63344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Cl)C.COC1=C(C=C2C(=C1)C(=NC=N2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC.Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Cl)C.COC1=C(C=C2C(=C1)C(=NC=N2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)OC.Cl

InChI

InChI=1S/C20H16N2O4S.C16H14ClN3.ClH/c1-25-18-10-16-17(11-19(18)26-2)21-12-22-20(16)27(23,24)15-8-7-13-5-3-4-6-14(13)9-15;1-10-6-14-15(7-11(10)2)18-9-19-16(14)20-13-5-3-4-12(17)8-13;/h3-12H,1-2H3;3-9H,1-2H3,(H,18,19,20);1H