ethyl 2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-oxobenzothiophen-2-ylidene)methylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate CAS Name: 2-[(3-oxo-1-benzothiophen-2-ylidene)methylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-oxo-1-benzothiophen-2-ylidene)methylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Traditional Name: 2-[(3-ketobenzothiophen-2-ylidene)methylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester Formula: C21H21NO3S2 MolecularWeight: 399.52634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCCC2)NC=C3C(=O)C4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCCC2)NC=C3C(=O)C4=CC=CC=C4S3

InChI

InChI=1S/C21H21NO3S2/c1-2-25-21(24)18-13-8-4-3-5-10-15(13)27-20(18)22-12-17-19(23)14-9-6-7-11-16(14)26-17/h6-7,9,11-12,22H,2-5,8,10H2,1H3