1-(2-cyanoethyl)-1-phenyl-3-prop-2-enyl-thiourea

Systemtic Name: 1-(2-cyanoethyl)-1-phenyl-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-(2-cyanoethyl)-1-phenyl-thiourea CAS Name: 1-(2-cyanoethyl)-1-phenyl-3-prop-2-enylthiourea IUPAC Name: 1-(2-cyanoethyl)-1-phenyl-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-(2-cyanoethyl)-1-phenyl-thiourea Formula: C13H15N3S MolecularWeight: 245.3433

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N(CCC#N)C1=CC=CC=C1

Isomeric SMILES

C=CCNC(=S)N(CCC#N)C1=CC=CC=C1

InChI

InChI=1S/C13H15N3S/c1-2-10-15-13(17)16(11-6-9-14)12-7-4-3-5-8-12/h2-5,7-8H,1,6,10-11H2,(H,15,17)