2-[(E)-(3-bromophenyl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[(E)-(3-bromophenyl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(E)-(3-bromophenyl)methyleneamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(E)-(3-bromophenyl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(E)-(3-bromophenyl)methylideneamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(E)-(3-bromobenzylidene)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C17H15BrN2S MolecularWeight: 359.2834

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)N=CC3=CC(=CC=C3)Br

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)/N=C/C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H15BrN2S/c1-11-5-6-14-15(9-19)17(21-16(14)7-11)20-10-12-3-2-4-13(18)8-12/h2-4,8,10-11H,5-7H2,1H3/b20-10+