(E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloranyl-7-methyl-quinolin-3-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloranyl-7-methyl-quinolin-3-yl)prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloro-7-methyl-3-quinolyl)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloro-7-methyl-3-quinolinyl)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloro-7-methylquinolin-3-yl)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzothiazol-2-yl)-3-(2-chloro-7-methyl-3-quinolyl)acrylonitrile Formula: C20H12ClN3S MolecularWeight: 361.84738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C=C(C#N)C3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)/C=C(\C#N)/C3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H12ClN3S/c1-12-6-7-13-9-14(19(21)23-17(13)8-12)10-15(11-22)20-24-16-4-2-3-5-18(16)25-20/h2-10H,1H3/b15-10+