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

Systemtic Name: 1-[4-chloranyl-1-(phenylmethyl)pyrazol-3-yl]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-(1-benzyl-4-chloro-pyrazol-3-yl)thiourea CAS Name: 1-[4-chloro-1-(phenylmethyl)-3-pyrazolyl]-3-prop-2-enylthiourea IUPAC Name: 1-(1-benzyl-4-chloropyrazol-3-yl)-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-(1-benzyl-4-chloro-pyrazol-3-yl)thiourea Formula: C14H15ClN4S MolecularWeight: 306.8137

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC1=NN(C=C1Cl)CC2=CC=CC=C2

Isomeric SMILES

C=CCNC(=S)NC1=NN(C=C1Cl)CC2=CC=CC=C2

InChI

InChI=1S/C14H15ClN4S/c1-2-8-16-14(20)17-13-12(15)10-19(18-13)9-11-6-4-3-5-7-11/h2-7,10H,1,8-9H2,(H2,16,17,18,20)