N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-1-(phenylsulfonyl)indole-3-carboxamide

Systemtic Name: N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]-1-(phenylsulfonyl)indole-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]indole-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]-4-pyrimidinyl]-3-indolecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]indole-3-carboxamide Traditional Name: 1-besyl-N-ethyl-N-[2-[[(1R)-1-phenylethyl]amino]pyrimidin-4-yl]indole-3-carboxamide Formula: C29H27N5O3S MolecularWeight: 525.62138

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC(=NC=C1)NC(C)C2=CC=CC=C2)C(=O)C3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCN(C1=NC(=NC=C1)N[C@H](C)C2=CC=CC=C2)C(=O)C3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H27N5O3S/c1-3-33(27-18-19-30-29(32-27)31-21(2)22-12-6-4-7-13-22)28(35)25-20-34(26-17-11-10-16-24(25)26)38(36,37)23-14-8-5-9-15-23/h4-21H,3H2,1-2H3,(H,30,31,32)/t21-/m1/s1