N-[4-(cyanomethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C18H18N2OS/c19-11-10-13-6-8-15(9-7-13)20-18(21)17-12-14-4-2-1-3-5-16(14)22-17/h6-9,12H,1-5,10H2,(H,20,21)