1-(2-methoxyethyl)-3-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylideneamino]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylideneamino]thiourea Openeye Name: 1-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-(2-methoxyethyl)-3-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methylideneamino]thiourea IUPAC Name: 1-[(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]-3-(2-methoxyethyl)thiourea Formula: C19H21N5OS2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NN=CC1=CN(N=C1C2=CC=CS2)CC3=CC=CC=C3

Isomeric SMILES

COCCNC(=S)NN=CC1=CN(N=C1C2=CC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C19H21N5OS2/c1-25-10-9-20-19(26)22-21-12-16-14-24(13-15-6-3-2-4-7-15)23-18(16)17-8-5-11-27-17/h2-8,11-12,14H,9-10,13H2,1H3,(H2,20,22,26)