1-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methylamino]-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methylamino]-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methylamino]-3-(4-morpholinosulfonylphenyl)thiourea Formula: C19H23N5O5S2 MolecularWeight: 465.54642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C1=O)CO

InChI

InChI=1S/C19H23N5O5S2/c1-13-18(26)17(14(12-25)10-20-13)11-21-23-19(30)22-15-2-4-16(5-3-15)31(27,28)24-6-8-29-9-7-24/h2-5,10-11,21,25H,6-9,12H2,1H3,(H2,22,23,30)