N-(4-bromanyl-3-methyl-phenyl)-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-1-[5-(1-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]-2-pyrrolecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-1-(5-pyrrolidin-1-yl-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-1-(5-pyrrolidino-1,3,4-thiadiazol-2-yl)pyrrole-2-carboxamide Formula: C18H18BrN5OS MolecularWeight: 432.33742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=CN2C3=NN=C(S3)N4CCCC4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=CN2C3=NN=C(S3)N4CCCC4)Br

InChI

InChI=1S/C18H18BrN5OS/c1-12-11-13(6-7-14(12)19)20-16(25)15-5-4-10-24(15)18-22-21-17(26-18)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,20,25)