1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[1-(4-cyanobutyl)pyrazol-4-yl]thiourea CAS Name: 1-[1-(4-cyanobutyl)-4-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-[1-(4-cyanobutyl)pyrazol-4-yl]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[1-(4-cyanobutyl)pyrazol-4-yl]thiourea Formula: C12H17N5S MolecularWeight: 263.36188

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=CN(N=C1)CCCCC#N

Isomeric SMILES

C=CCNC(=S)NC1=CN(N=C1)CCCCC#N

InChI

InChI=1S/C12H17N5S/c1-2-7-14-12(18)16-11-9-15-17(10-11)8-5-3-4-6-13/h2,9-10H,1,3-5,7-8H2,(H2,14,16,18)