1,3-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiourea

Systemtic Name: 1,3-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiourea Openeye Name: 1,3-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiourea CAS Name: 1,3-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiourea IUPAC Name: 1,3-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiourea Traditional Name: 1,3-bis(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)thiourea Formula: C21H22N4S3 MolecularWeight: 426.62118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2C#N)NC(=S)NC3=C(C4=C(S3)CCCCC4)C#N

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2C#N)NC(=S)NC3=C(C4=C(S3)CCCCC4)C#N

InChI

InChI=1S/C21H22N4S3/c22-11-15-13-7-3-1-5-9-17(13)27-19(15)24-21(26)25-20-16(12-23)14-8-4-2-6-10-18(14)28-20/h1-10H2,(H2,24,25,26)