1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-prop-2-enyl-thiourea

Systemtic Name: 1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiourea CAS Name: 1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-prop-2-enylthiourea IUPAC Name: 1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiourea Formula: C13H15N3S2 MolecularWeight: 277.4083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=C(C2=C(S1)CCCC2)C#N

Isomeric SMILES

C=CCNC(=S)NC1=C(C2=C(S1)CCCC2)C#N

InChI

InChI=1S/C13H15N3S2/c1-2-7-15-13(17)16-12-10(8-14)9-5-3-4-6-11(9)18-12/h2H,1,3-7H2,(H2,15,16,17)