3-diethoxyphosphinothioyloxy-5-[(4-propan-2-ylphenyl)amino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-diethoxyphosphinothioyloxy-5-[(4-propan-2-ylphenyl)amino]-1,2-thiazole-4-carbonitrile Openeye Name: 3-diethoxyphosphinothioyloxy-5-(4-isopropylanilino)isothiazole-4-carbonitrile CAS Name: 3-diethoxyphosphinothioyloxy-5-(4-propan-2-ylanilino)-4-isothiazolecarbonitrile IUPAC Name: 3-diethoxyphosphinothioyloxy-5-(4-propan-2-ylanilino)-1,2-thiazole-4-carbonitrile Traditional Name: 5-cumidino-3-diethoxythiophosphoryloxy-isothiazole-4-carbonitrile Formula: C17H22N3O3PS2 MolecularWeight: 411.478641

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=S)(OCC)OC1=NSC(=C1C#N)NC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOP(=S)(OCC)OC1=NSC(=C1C#N)NC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C17H22N3O3PS2/c1-5-21-24(25,22-6-2)23-16-15(11-18)17(26-20-16)19-14-9-7-13(8-10-14)12(3)4/h7-10,12,19H,5-6H2,1-4H3