1-(2-tert-butyl-5-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)thiourea

Systemtic Name: 1-(2-tert-butyl-5-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)thiourea Openeye Name: (2-tert-butyl-5-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)thiourea CAS Name: [2-tert-butyl-5-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]thiourea IUPAC Name: (2-tert-butyl-5-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)thiourea Traditional Name: (2-tert-butyl-5-pyrrolidino-1,3-benzothiazol-6-yl)thiourea Formula: C16H22N4S2 MolecularWeight: 334.50268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC(=C(C=C2S1)NC(=S)N)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=NC2=CC(=C(C=C2S1)NC(=S)N)N3CCCC3

InChI

InChI=1S/C16H22N4S2/c1-16(2,3)14-18-11-8-12(20-6-4-5-7-20)10(19-15(17)21)9-13(11)22-14/h8-9H,4-7H2,1-3H3,(H3,17,19,21)