1-tert-butyl-3-[(Z)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-tert-butyl-3-[(Z)-[1-(phenylmethyl)pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-[(Z)-(1-benzylpyrazol-4-yl)methyleneamino]-3-tert-butyl-thiourea CAS Name: 1-tert-butyl-3-[(Z)-[1-(phenylmethyl)-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-[(Z)-(1-benzylpyrazol-4-yl)methylideneamino]-3-tert-butylthiourea Traditional Name: 1-[(Z)-(1-benzylpyrazol-4-yl)methyleneamino]-3-tert-butyl-thiourea Formula: C16H21N5S MolecularWeight: 315.43644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NN=CC1=CN(N=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=S)N/N=C\C1=CN(N=C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N5S/c1-16(2,3)19-15(22)20-17-9-14-10-18-21(12-14)11-13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3,(H2,19,20,22)/b17-9-