1-[(Z)-(3-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(Z)-(3-ethoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(Z)-(3-ethoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-1-methyl-thiourea CAS Name: 1-[(Z)-(3-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(Z)-(3-ethoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1-methylthiourea Traditional Name: 3-benzyl-1-[(Z)-(3-ethoxy-4-propargyloxy-benzylidene)amino]-1-methyl-thiourea Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NN(C)C(=S)NCC2=CC=CC=C2)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N\N(C)C(=S)NCC2=CC=CC=C2)OCC#C

InChI

InChI=1S/C21H23N3O2S/c1-4-13-26-19-12-11-18(14-20(19)25-5-2)16-23-24(3)21(27)22-15-17-9-7-6-8-10-17/h1,6-12,14,16H,5,13,15H2,2-3H3,(H,22,27)/b23-16-