1-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-3-(2-methoxyethyl)thiourea

Systemtic Name: 1-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-3-(2-methoxyethyl)thiourea Openeye Name: 1-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-[(Z)-[1-(2-cyanoethyl)-3-phenyl-4-pyrazolyl]methylideneamino]-3-(2-methoxyethyl)thiourea IUPAC Name: 1-[(Z)-[1-(2-cyanoethyl)-3-phenylpyrazol-4-yl]methylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[(Z)-[1-(2-cyanoethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea Formula: C17H20N6OS MolecularWeight: 356.4453

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NN=CC1=CN(N=C1C2=CC=CC=C2)CCC#N

Isomeric SMILES

COCCNC(=S)N/N=C\C1=CN(N=C1C2=CC=CC=C2)CCC#N

InChI

InChI=1S/C17H20N6OS/c1-24-11-9-19-17(25)21-20-12-15-13-23(10-5-8-18)22-16(15)14-6-3-2-4-7-14/h2-4,6-7,12-13H,5,9-11H2,1H3,(H2,19,21,25)/b20-12-