N1,N3-bis[5-[carbamimidoyl(ethyl)carbamoyl]-1-propyl-pyrrol-3-yl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[5-[carbamimidoyl(ethyl)carbamoyl]-1-propyl-pyrrol-3-yl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[5-[carbamimidoyl(ethyl)carbamoyl]-1-propyl-pyrrol-3-yl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[5-[[carbamimidoyl(ethyl)amino]-oxomethyl]-1-propyl-3-pyrrolyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[5-[carbamimidoyl(ethyl)carbamoyl]-1-propylpyrrol-3-yl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[5-[amidino(ethyl)carbamoyl]-1-propyl-pyrrol-3-yl]isophthalamide Formula: C30H40N10O4 MolecularWeight: 604.7032

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)N(CC)C(=N)N)NC(=O)C2=CC(=CC=C2)C(=O)NC3=CN(C(=C3)C(=O)N(CC)C(=N)N)CCC

Isomeric SMILES

CCCN1C=C(C=C1C(=O)N(CC)C(=N)N)NC(=O)C2=CC(=CC=C2)C(=O)NC3=CN(C(=C3)C(=O)N(CC)C(=N)N)CCC

InChI

InChI=1S/C30H40N10O4/c1-5-12-37-17-21(15-23(37)27(43)39(7-3)29(31)32)35-25(41)19-10-9-11-20(14-19)26(42)36-22-16-24(38(18-22)13-6-2)28(44)40(8-4)30(33)34/h9-11,14-18H,5-8,12-13H2,1-4H3,(H3,31,32)(H3,33,34)(H,35,41)(H,36,42)