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1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea

1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea

Systemtic Name:1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea
Openeye Name:1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea
CAS Name:1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea
IUPAC Name:1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea
Traditional Name:1-(cyclopropylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)thiourea
Formula: C12H12N4O2S2
MolecularWeight: 308.37928
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

C1CC1CNC(=S)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C12H12N4O2S2/c17-16(18)8-3-4-9-10(5-8)20-12(14-9)15-11(19)13-6-7-1-2-7/h3-5,7H,1-2,6H2,(H2,13,14,15,19)


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