N-[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-phenyl-propanamide

Systemtic Name: N-[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-phenyl-propanamide Openeye Name: N-[2-[(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-phenyl-propanamide CAS Name: N-[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-phenylpropanamide IUPAC Name: N-[2-[(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-phenylpropanamide Traditional Name: N-[2-[(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)amino]ethyl]-3-phenyl-propionamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C3=C(CCCC3)SC2=N1)NCCNC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C2C3=C(CCCC3)SC2=N1)NCCNC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H26N4OS/c1-15-25-21(20-17-9-5-6-10-18(17)28-22(20)26-15)24-14-13-23-19(27)12-11-16-7-3-2-4-8-16/h2-4,7-8H,5-6,9-14H2,1H3,(H,23,27)(H,24,25,26)