2-chloranyl-N-[3-(3-methylphenyl)sulfanylpropyl]quinazolin-4-amine

Systemtic Name: 2-chloranyl-N-[3-(3-methylphenyl)sulfanylpropyl]quinazolin-4-amine Openeye Name: 2-chloro-N-[3-(m-tolylsulfanyl)propyl]quinazolin-4-amine CAS Name: 2-chloro-N-[3-[(3-methylphenyl)thio]propyl]-4-quinazolinamine IUPAC Name: 2-chloro-N-[3-(3-methylphenyl)sulfanylpropyl]quinazolin-4-amine Traditional Name: (2-chloroquinazolin-4-yl)-[3-(m-tolylthio)propyl]amine Formula: C18H18ClN3S MolecularWeight: 343.87362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SCCCNC2=NC(=NC3=CC=CC=C32)Cl

Isomeric SMILES

CC1=CC(=CC=C1)SCCCNC2=NC(=NC3=CC=CC=C32)Cl

InChI

InChI=1S/C18H18ClN3S/c1-13-6-4-7-14(12-13)23-11-5-10-20-17-15-8-2-3-9-16(15)21-18(19)22-17/h2-4,6-9,12H,5,10-11H2,1H3,(H,20,21,22)