2-[(8-chloranylquinolin-4-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[(8-chloranylquinolin-4-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(8-chloro-4-quinolyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(8-chloro-4-quinolinyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(8-chloroquinolin-4-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(8-chloro-4-quinolyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C18H14ClN3S MolecularWeight: 339.84186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC3=C4C=CC=C(C4=NC=C3)Cl)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC3=C4C=CC=C(C4=NC=C3)Cl)C#N

InChI

InChI=1S/C18H14ClN3S/c19-14-6-3-5-12-15(8-9-21-17(12)14)22-18-13(10-20)11-4-1-2-7-16(11)23-18/h3,5-6,8-9H,1-2,4,7H2,(H,21,22)