1-[(E)-(3-bromanyl-4-prop-2-ynoxy-phenyl)methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[(E)-(3-bromanyl-4-prop-2-ynoxy-phenyl)methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[(E)-(3-bromo-4-prop-2-ynoxy-phenyl)methyleneamino]-3-ethyl-thiourea CAS Name: 1-[(E)-(3-bromo-4-prop-2-ynoxyphenyl)methylideneamino]-3-ethylthiourea IUPAC Name: 1-[(E)-(3-bromo-4-prop-2-ynoxyphenyl)methylideneamino]-3-ethylthiourea Traditional Name: 1-[(E)-(3-bromo-4-propargyloxy-benzylidene)amino]-3-ethyl-thiourea Formula: C13H14BrN3OS MolecularWeight: 340.23876

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=CC(=C(C=C1)OCC#C)Br

Isomeric SMILES

CCNC(=S)N/N=C/C1=CC(=C(C=C1)OCC#C)Br

InChI

InChI=1S/C13H14BrN3OS/c1-3-7-18-12-6-5-10(8-11(12)14)9-16-17-13(19)15-4-2/h1,5-6,8-9H,4,7H2,2H3,(H2,15,17,19)/b16-9+