1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-propyl-thiourea

Systemtic Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-propyl-thiourea Openeye Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-propyl-thiourea CAS Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-propylthiourea IUPAC Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-propylthiourea Traditional Name: 1-(5,6-dimethyl-1,3-benzothiazol-2-yl)-3-propyl-thiourea Formula: C13H17N3S2 MolecularWeight: 279.42418

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NC1=NC2=C(S1)C=C(C(=C2)C)C

Isomeric SMILES

CCCNC(=S)NC1=NC2=C(S1)C=C(C(=C2)C)C

InChI

InChI=1S/C13H17N3S2/c1-4-5-14-12(17)16-13-15-10-6-8(2)9(3)7-11(10)18-13/h6-7H,4-5H2,1-3H3,(H2,14,15,16,17)