butanedioic acid; 5-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-benzothiazol-2-amine

Systemtic Name: butanedioic acid; 5-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-benzothiazol-2-amine Openeye Name: 5-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-benzothiazol-2-amine; succinic acid CAS Name: butanedioic acid; 5-methoxy-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1,3-benzothiazol-2-amine IUPAC Name: butanedioic acid; 5-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,3-benzothiazol-2-amine Traditional Name: (5-methoxy-1,3-benzothiazol-2-yl)-[4-(2-pyrrolidinoethoxy)phenyl]amine; succinic acid Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=N2)NC3=CC=C(C=C3)OCCN4CCCC4.C(CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=N2)NC3=CC=C(C=C3)OCCN4CCCC4.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C20H23N3O2S.C4H6O4/c1-24-17-8-9-19-18(14-17)22-20(26-19)21-15-4-6-16(7-5-15)25-13-12-23-10-2-3-11-23;5-3(6)1-2-4(7)8/h4-9,14H,2-3,10-13H2,1H3,(H,21,22);1-2H2,(H,5,6)(H,7,8)