1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3-chloranyl-2-methyl-phenyl)thiourea

Systemtic Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3-chloranyl-2-methyl-phenyl)thiourea Openeye Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3-chloro-2-methyl-phenyl)thiourea CAS Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3-chloro-2-methylphenyl)thiourea IUPAC Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3-chloro-2-methylphenyl)thiourea Traditional Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-(3-chloro-2-methyl-phenyl)thiourea Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NN=C(C)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)N/N=C(\C)/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16ClN3O2S/c1-10-13(18)4-3-5-14(10)19-17(24)21-20-11(2)12-6-7-15-16(8-12)23-9-22-15/h3-8H,9H2,1-2H3,(H2,19,21,24)/b20-11+