N-[2-(3,4-dimethylphenyl)sulfanyl-5-methyl-phenyl]-7-propyl-1,8-naphthyridin-4-amine

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanyl-5-methyl-phenyl]-7-propyl-1,8-naphthyridin-4-amine Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanyl-5-methyl-phenyl]-7-propyl-1,8-naphthyridin-4-amine CAS Name: N-[2-[(3,4-dimethylphenyl)thio]-5-methylphenyl]-7-propyl-1,8-naphthyridin-4-amine IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanyl-5-methylphenyl]-7-propyl-1,8-naphthyridin-4-amine Traditional Name: [2-[(3,4-dimethylphenyl)thio]-5-methyl-phenyl]-(7-propyl-1,8-naphthyridin-4-yl)amine Formula: C26H27N3S MolecularWeight: 413.57768

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=NC=CC(=C2C=C1)NC3=C(C=CC(=C3)C)SC4=CC(=C(C=C4)C)C

Isomeric SMILES

CCCC1=NC2=NC=CC(=C2C=C1)NC3=C(C=CC(=C3)C)SC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C26H27N3S/c1-5-6-20-9-11-22-23(13-14-27-26(22)28-20)29-24-15-17(2)7-12-25(24)30-21-10-8-18(3)19(4)16-21/h7-16H,5-6H2,1-4H3,(H,27,28,29)