[(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] N-methyl-N-piperazin-1-yl-carbamate

Systemtic Name: [(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] N-methyl-N-piperazin-1-yl-carbamate Openeye Name: [(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] N-methyl-N-piperazin-1-yl-carbamate CAS Name: N-methyl-N-(1-piperazinyl)carbamic acid [(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] ester IUPAC Name: [(E)-1-(4-diethoxyphosphinothioyloxyphenyl)ethylideneamino] N-methyl-N-piperazin-1-ylcarbamate Traditional Name: N-methyl-N-piperazino-carbamic acid [(E)-1-(4-diethoxythiophosphoryloxyphenyl)ethylideneamino] ester Formula: C18H29N4O5PS MolecularWeight: 444.485421

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=CC=C(C=C1)C(=NOC(=O)N(C)N2CCNCC2)C

Isomeric SMILES

CCOP(=S)(OCC)OC1=CC=C(C=C1)/C(=N/OC(=O)N(C)N2CCNCC2)/C

InChI

InChI=1S/C18H29N4O5PS/c1-5-24-28(29,25-6-2)27-17-9-7-16(8-10-17)15(3)20-26-18(23)21(4)22-13-11-19-12-14-22/h7-10,19H,5-6,11-14H2,1-4H3/b20-15+