N-[4-methoxy-7-[2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl]-1,3-benzothiazol-2-yl]-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-[4-methoxy-7-[2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl]-1,3-benzothiazol-2-yl]-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-[4-methoxy-7-[2-(6-methyl-3-pyridyl)thiazol-4-yl]-1,3-benzothiazol-2-yl]-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-[4-methoxy-7-[2-(6-methyl-3-pyridinyl)-4-thiazolyl]-1,3-benzothiazol-2-yl]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-[4-methoxy-7-[2-(6-methylpyridin-3-yl)-1,3-thiazol-4-yl]-1,3-benzothiazol-2-yl]-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-[4-methoxy-7-[2-(6-methyl-3-pyridyl)thiazol-4-yl]-1,3-benzothiazol-2-yl]-4-(pyrrolidinomethyl)benzamide Formula: C29H27N5O2S2 MolecularWeight: 541.68698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C2=NC(=CS2)C3=C4C(=C(C=C3)OC)N=C(S4)NC(=O)C5=CC=C(C=C5)CN6CCCC6

Isomeric SMILES

CC1=NC=C(C=C1)C2=NC(=CS2)C3=C4C(=C(C=C3)OC)N=C(S4)NC(=O)C5=CC=C(C=C5)CN6CCCC6

InChI

InChI=1S/C29H27N5O2S2/c1-18-5-8-21(15-30-18)28-31-23(17-37-28)22-11-12-24(36-2)25-26(22)38-29(32-25)33-27(35)20-9-6-19(7-10-20)16-34-13-3-4-14-34/h5-12,15,17H,3-4,13-14,16H2,1-2H3,(H,32,33,35)