1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(Z)-quinoxalin-2-ylmethylideneamino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(Z)-quinoxalin-2-ylmethylideneamino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(Z)-quinoxalin-2-ylmethyleneamino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(Z)-2-quinoxalinylmethylideneamino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(Z)-quinoxalin-2-ylmethylideneamino]thiourea Traditional Name: 1-homoveratryl-3-[(Z)-quinoxalin-2-ylmethyleneamino]thiourea Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NN=CC2=NC3=CC=CC=C3N=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)N/N=C\C2=NC3=CC=CC=C3N=C2)OC

InChI

InChI=1S/C20H21N5O2S/c1-26-18-8-7-14(11-19(18)27-2)9-10-21-20(28)25-23-13-15-12-22-16-5-3-4-6-17(16)24-15/h3-8,11-13H,9-10H2,1-2H3,(H2,21,25,28)/b23-13-