3-(7-chloranylquinazolin-6-yl)sulfanyl-4-[(3-ethynylphenyl)amino]-2-methyl-benzenecarbonitrile

Systemtic Name: 3-(7-chloranylquinazolin-6-yl)sulfanyl-4-[(3-ethynylphenyl)amino]-2-methyl-benzenecarbonitrile Openeye Name: 3-(7-chloroquinazolin-6-yl)sulfanyl-4-(3-ethynylanilino)-2-methyl-benzonitrile CAS Name: 3-[(7-chloro-6-quinazolinyl)thio]-4-(3-ethynylanilino)-2-methylbenzonitrile IUPAC Name: 3-(7-chloroquinazolin-6-yl)sulfanyl-4-(3-ethynylanilino)-2-methylbenzonitrile Traditional Name: 3-[(7-chloroquinazolin-6-yl)thio]-4-(3-ethynylanilino)-2-methyl-benzonitrile Formula: C24H15ClN4S MolecularWeight: 426.9207

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1SC2=C(C=C3C(=C2)C=NC=N3)Cl)NC4=CC=CC(=C4)C#C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1SC2=C(C=C3C(=C2)C=NC=N3)Cl)NC4=CC=CC(=C4)C#C)C#N

InChI

InChI=1S/C24H15ClN4S/c1-3-16-5-4-6-19(9-16)29-21-8-7-17(12-26)15(2)24(21)30-23-10-18-13-27-14-28-22(18)11-20(23)25/h1,4-11,13-14,29H,2H3