2-[(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile

Systemtic Name: 2-[(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Openeye Name: 2-[(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile CAS Name: 2-[[4-(methylthio)-1,3-benzothiazol-2-yl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile IUPAC Name: 2-[(4-methylsulfanyl-1,3-benzothiazol-2-yl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Traditional Name: 2-[[4-(methylthio)-1,3-benzothiazol-2-yl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile Formula: C18H17N3S3 MolecularWeight: 371.54268

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)NC3=C(C4=C(S3)CCCCC4)C#N

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)NC3=C(C4=C(S3)CCCCC4)C#N

InChI

InChI=1S/C18H17N3S3/c1-22-14-8-5-9-15-16(14)20-18(24-15)21-17-12(10-19)11-6-3-2-4-7-13(11)23-17/h5,8-9H,2-4,6-7H2,1H3,(H,20,21)