1-[(E)-2-ethylbutylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[(E)-2-ethylbutylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[(E)-2-ethylbutylideneamino]-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-[(E)-2-ethylbutylideneamino]-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(E)-2-ethylbutylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-[(E)-2-ethylbutylideneamino]-3-(4-morpholinosulfonylphenyl)thiourea Formula: C17H26N4O3S2 MolecularWeight: 398.54334

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C=NNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CCC(CC)/C=N/NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C17H26N4O3S2/c1-3-14(4-2)13-18-20-17(25)19-15-5-7-16(8-6-15)26(22,23)21-9-11-24-12-10-21/h5-8,13-14H,3-4,9-12H2,1-2H3,(H2,19,20,25)/b18-13+