1H-benzimidazol-2-yl-(2-chloranyl-7-methyl-quinolin-3-yl)methanethiol

Systemtic Name: 1H-benzimidazol-2-yl-(2-chloranyl-7-methyl-quinolin-3-yl)methanethiol Openeye Name: 1H-benzimidazol-2-yl-(2-chloro-7-methyl-3-quinolyl)methanethiol CAS Name: 1H-benzimidazol-2-yl-(2-chloro-7-methyl-3-quinolinyl)methanethiol IUPAC Name: 1H-benzimidazol-2-yl-(2-chloro-7-methylquinolin-3-yl)methanethiol Traditional Name: 1H-benzimidazol-2-yl-(2-chloro-7-methyl-3-quinolyl)methanethiol Formula: C18H14ClN3S MolecularWeight: 339.84186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(C3=NC4=CC=CC=C4N3)S)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C(C3=NC4=CC=CC=C4N3)S)Cl

InChI

InChI=1S/C18H14ClN3S/c1-10-6-7-11-9-12(17(19)20-15(11)8-10)16(23)18-21-13-4-2-3-5-14(13)22-18/h2-9,16,23H,1H3,(H,21,22)