1-(1,3-benzodioxol-5-yl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea Formula: C16H17N3O2S2 MolecularWeight: 347.45508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H17N3O2S2/c1-9-2-4-11-14(6-9)23-16(18-11)19-15(22)17-10-3-5-12-13(7-10)21-8-20-12/h3,5,7,9H,2,4,6,8H2,1H3,(H2,17,18,19,22)