2-chloranyl-1,3-benzothiazole; N-(2-piperidin-1-ylethyl)-1,3-benzothiazol-2-amine

Systemtic Name: 2-chloranyl-1,3-benzothiazole; N-(2-piperidin-1-ylethyl)-1,3-benzothiazol-2-amine Openeye Name: 2-chloro-1,3-benzothiazole; N-[2-(1-piperidyl)ethyl]-1,3-benzothiazol-2-amine CAS Name: 2-chloro-1,3-benzothiazole; N-[2-(1-piperidinyl)ethyl]-1,3-benzothiazol-2-amine IUPAC Name: 2-chloro-1,3-benzothiazole; N-(2-piperidin-1-ylethyl)-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl(2-piperidinoethyl)amine; 2-chloro-1,3-benzothiazole Formula: C21H23ClN4S2 MolecularWeight: 431.01712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=NC3=CC=CC=C3S2.C1=CC=C2C(=C1)N=C(S2)Cl

Isomeric SMILES

C1CCN(CC1)CCNC2=NC3=CC=CC=C3S2.C1=CC=C2C(=C1)N=C(S2)Cl

InChI

InChI=1S/C14H19N3S.C7H4ClNS/c1-4-9-17(10-5-1)11-8-15-14-16-12-6-2-3-7-13(12)18-14;8-7-9-5-3-1-2-4-6(5)10-7/h2-3,6-7H,1,4-5,8-11H2,(H,15,16);1-4H