1-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[4-(1,3-dithian-2-yl)benzoyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[4-(1,3-dithian-2-yl)benzoyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[4-(1,3-dithian-2-yl)benzoyl]amino]-3-isoamyl-thiourea Formula: C17H25N3OS3 MolecularWeight: 383.5949

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CC=C(C=C1)C2SCCCS2

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CC=C(C=C1)C2SCCCS2

InChI

InChI=1S/C17H25N3OS3/c1-12(2)8-9-18-17(22)20-19-15(21)13-4-6-14(7-5-13)16-23-10-3-11-24-16/h4-7,12,16H,3,8-11H2,1-2H3,(H,19,21)(H2,18,20,22)