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

Systemtic Name: 1-(2-cyanoethyl)-1-(phenylmethyl)-3-prop-2-enyl-thiourea Openeye Name: 3-allyl-1-benzyl-1-(2-cyanoethyl)thiourea CAS Name: 1-(2-cyanoethyl)-1-(phenylmethyl)-3-prop-2-enylthiourea IUPAC Name: 1-benzyl-1-(2-cyanoethyl)-3-prop-2-enylthiourea Traditional Name: 3-allyl-1-benzyl-1-(2-cyanoethyl)thiourea Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N(CCC#N)CC1=CC=CC=C1

Isomeric SMILES

C=CCNC(=S)N(CCC#N)CC1=CC=CC=C1

InChI

InChI=1S/C14H17N3S/c1-2-10-16-14(18)17(11-6-9-15)12-13-7-4-3-5-8-13/h2-5,7-8H,1,6,10-12H2,(H,16,18)